N-[(4-methylphenyl)methyl]-5-pyrrolidin-1-ylsulfonyl-pyridin-1-ium-2-amine

Systemtic Name: N-[(4-methylphenyl)methyl]-5-pyrrolidin-1-ylsulfonyl-pyridin-1-ium-2-amine Openeye Name: N-(p-tolylmethyl)-5-pyrrolidin-1-ylsulfonyl-pyridin-1-ium-2-amine CAS Name: N-[(4-methylphenyl)methyl]-5-(1-pyrrolidinylsulfonyl)-2-pyridin-1-iumamine IUPAC Name: N-[(4-methylphenyl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-1-ium-2-amine Traditional Name: (4-methylbenzyl)-(5-pyrrolidinosulfonylpyridin-1-ium-2-yl)amine Formula: C17H22N3O2S+ MolecularWeight: 332.44048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=[NH+]C=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=[NH+]C=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C17H21N3O2S/c1-14-4-6-15(7-5-14)12-18-17-9-8-16(13-19-17)23(21,22)20-10-2-3-11-20/h4-9,13H,2-3,10-12H2,1H3,(H,18,19)/p+1